Geometry & MOs

Info

ID:	30221
PubChem CID:	840804
Reduced:	O2N3C11H11 (1)
Stoich.:	A2B3C11D11 (1)
Weight, g/mol:	341.173942
ΔH_f, kcal/mol:	-35.4
Dipole, Da:	2.61
IP(EA), eV:	-9.21(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(4-ethoxyanilino)-N-[(4-hydroxyphenyl)methylideneamino]butanamide

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C(=O)N1NC(=O)C

DOS

IR

Vibrations